2-(4-chlorophenoxy)-N-cyclopropylacetamide

C11H12ClNO2 — CID 2899705

IUPAC2-(4-chlorophenoxy)-N-cyclopropylacetamide
SMILESO=C(COc1ccc(Cl)cc1)NC1CC1
InChIInChI=1S/C11H12ClNO2/c12-8-1-5-10(6-2-8)15-7-11(14)13-9-3-4-9/h1-2,5-6,9H,3-4,7H2,(H,13,14)
InChIKeyUIMVUHMPKRFPSO-UHFFFAOYSA-N
MW225.68 g/mol
LogP2.00
Rot. Bonds4

About 2-(4-chlorophenoxy)-N-cyclopropylacetamide

2-(4-chlorophenoxy)-N-cyclopropylacetamide (PubChem CID 2899705) has the molecular formula C11H12ClNO2 and a molecular weight of 225.68 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-cyclopropylacetamide
PubChem CID2899705
Molecular FormulaC11H12ClNO2
Molecular Weight225.68 g/mol
Exact Mass225.06
IUPAC Name2-(4-chlorophenoxy)-N-cyclopropylacetamide
SMILESO=C(COc1ccc(Cl)cc1)NC1CC1
InChIInChI=1S/C11H12ClNO2/c12-8-1-5-10(6-2-8)15-7-11(14)13-9-3-4-9/h1-2,5-6,9H,3-4,7H2,(H,13,14)
InChIKeyUIMVUHMPKRFPSO-UHFFFAOYSA-N
XLogP2.00
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.68
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-cyclopropylacetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-cyclopropylacetamide (CID 2899705) is 2-(4-chlorophenoxy)-N-cyclopropylacetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-cyclopropylacetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-cyclopropylacetamide is O=C(COc1ccc(Cl)cc1)NC1CC1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-cyclopropylacetamide?
The InChIKey is UIMVUHMPKRFPSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClNO2/c12-8-1-5-10(6-2-8)15-7-11(14)13-9-3-4-9/h1-2,5-6,9H,3-4,7H2,(H,13,14).
What are the key properties of 2-(4-chlorophenoxy)-N-cyclopropylacetamide?
2-(4-chlorophenoxy)-N-cyclopropylacetamide has a molecular weight of 225.68 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-cyclopropylacetamide is sourced from PubChem (CID 2899705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).